[Wien] 4f Hubbard term

[karima Physique]

Dear Prof. Laurence Marks

Thank you very much

2017-11-24 14:44 GMT+01:00 Laurence Marks <L-marks at northwestern.edu>:

> I think this is right, but I have not checked the notes on the web site.
>
> Note: be careful about spin.
>
> On Fri, Nov 24, 2017 at 7:24 AM, karima Physique <
> physique.karima at gmail.com> wrote:
>
>> Dear Prof. Laurence Marks; Thank you for your reply and i have a last
>> question :
>>
>> can I write the estimation equation in this form:
>>
>> Ueff=[ E4f(up) * (+ 1/2 e)] - [ E4f(up) * (- 1/2 e)] - [ EF * (+ 1/2 e)]
>> + [ EF * (- 1/2 e)]
>>
>> Is this correct .?:
>>
>>
>> 2017-11-24 2:50 GMT+01:00 Laurence Marks <L-marks at northwestern.edu>:
>>
>>> In my experience, yes.
>>>
>>> On Nov 23, 2017 6:13 PM, "karima Physique" <physique.karima at gmail.com>
>>> wrote:
>>>
>>>> Dear wien2k users;
>>>>
>>>> can we use the method described by G. K. H. Madsen and P. Novák to
>>>> estimate the hubbard term for the 4f elements.?
>>>>
>>>
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>>
>
>
> --
> Professor Laurence Marks
> "Research is to see what everybody else has seen, and to think what nobody
> else has thought", Albert Szent-Gyorgi
> www.numis.northwestern.edu ; Corrosion in 4D:
> MURI4D.numis.northwestern.edu
> Partner of the CFW 100% program for gender equity, www.cfw.org/100-percent
> Co-Editor, Acta Cryst A
>
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